Glycoside
GD003330
Name:
NoneFormula:
C18H24O8Smiles:
COc1ccc(C=CC(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1OCAglycone:
COc1ccc(C=CC(C)=O)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 7 |
| MolWt: | 368.38 | Num_heavy_atoms: | 26 |
| TPSA: | 125.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD03034
Formula: C12H14O3
Smiles:
COc1ccc(C=CC(C)=O)cc1OC| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 206.24 | Num_heavy_atoms: | 15 |
| TPSA: | 35.53 | NumAromaticRings: | 1 |
